6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione

ChEBI ID	CHEBI:92053

Definition	A quinolone that is quinoline-5,8-dione substituted by chloro and [2-(morpholin-4-yl)ethyl]amino groups at positions 6 and 7, respectively. It is a potent and irreversible inhibitor of Cdc25 isoforms.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C15H16ClN3O3

Net Charge

Average Mass

321.760

Monoisotopic Mass

321.08802

InChI

InChI=1S/C15H16ClN3O3/c16-11-13(18-4-5-19-6-8-22-9-7-19)15(21)12-10(14(11)20)2-1-3-17-12/h1-3,18H,4-9H2

InChIKey

BMKPVDQDJQWBPD-UHFFFAOYSA-N

SMILES

ClC1=C(NCCN2CCOCC2)C(=O)C2=C(C=CC=N2)C1=O

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor An EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor which interferes with the activity of the enzyme protein tyrosine phosphatases (PTPs), EC 3.1.3.48, involved in the removal of phosphate groups from phosphorylated tyrosine residues on proteins.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053) has role antineoplastic agent (CHEBI:35610) 6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053) has role EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor (CHEBI:35608) 6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053) is a p-quinones (CHEBI:25830) 6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053) is a aminoquinoline (CHEBI:36709) 6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053) is a morpholines (CHEBI:38785) 6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053) is a organochlorine compound (CHEBI:36683) 6-chloro-7-[2-(4-morpholinyl)ethylamino]quinoline-5,8-dione (CHEBI:92053) is a quinolone (CHEBI:23765)

IUPAC Name

6-chloro-7-{[2-(morpholin-4-yl)ethyl]amino}quinoline-5,8-dione

Synonyms	Sources
6-chloro-7-(2-morpholin-4-yl-ethylamino)quinoline-5,8-dione	ChEBI
6-chloro-7-(2-morpholin-4-ylethylamino)-quinoline-5,8-dione	ChEBI
6-chloro-7-[[2-(4-morpholinyl)ethyl]amino]-5,8-quinolinedione	ChEBI
CDC25 phosphatase inhibitor II	ChEBI
DA-3003-01	DrugBank
DA-3003-1	ChEBI
DA3003-1	ChEBI
NSC 663284	ChEBI
NSC-663284	ChEBI
NSC663284	ChEBI
SPS8I1	ChEBI

Registry Number	Type	Source
383907-43-5	CAS Registry Number	ChEBI

Last Modified

14 June 2024